Exact conditions in finite-temperature density-functional theory S Pittalis, CR Proetto, A Floris, A Sanna, C Bersier, K Burke, EKU Gross Physical review letters 107 (16), 163001, 2011 | 122 | 2011 |
First-principles approach to noncollinear magnetism: Towards spin dynamics S Sharma, JK Dewhurst, C Ambrosch-Draxl, S Kurth, N Helbig, S Pittalis, ... Physical review letters 98 (19), 196405, 2007 | 119 | 2007 |
Thermal density functional theory in context A Pribram-Jones, S Pittalis, EKU Gross, K Burke Frontiers and Challenges in Warm Dense Matter, 25-60, 2014 | 90* | 2014 |
The elk FP-LAPW code K Dewhurst, S Sharma, L Nordstrom, F Cricchio, F Bultmark, H Gross, ... ELK, http://elk. sourceforge. net, 2016 | 78* | 2016 |
Hartree and exchange in ensemble density functional theory: Avoiding the nonuniqueness disaster T Gould, S Pittalis Physical review letters 119 (24), 243001, 2017 | 71 | 2017 |
Universal correction for the Becke–Johnson exchange potential E Räsänen, S Pittalis, CR Proetto The Journal of chemical physics 132 (4), 044112, 2010 | 71 | 2010 |
Locality of correlation in density functional theory K Burke, A Cancio, T Gould, S Pittalis The Journal of chemical physics 145 (5), 2016 | 57* | 2016 |
Electron-electron interactions in artificial graphene E Räsänen, CA Rozzi, S Pittalis, G Vignale Physical review letters 108 (24), 246803, 2012 | 52 | 2012 |
Lower bounds on the exchange-correlation energy in reduced dimensions E Räsänen, S Pittalis, K Capelle, CR Proetto Physical review letters 102 (20), 206406, 2009 | 52 | 2009 |
Density-driven correlations in many-electron ensembles: theory and application for excited states T Gould, S Pittalis Physical review letters 123, 016401, 2019 | 51 | 2019 |
Charge transfer excitations from exact and approximate ensemble Kohn-Sham theory T Gould, L Kronik, S Pittalis The Journal of chemical physics 148 (17), 2018 | 48 | 2018 |
Exchange-energy functionals for finite two-dimensional systems S Pittalis, E Räsänen, N Helbig, EKU Gross Physical Review B—Condensed Matter and Materials Physics 76 (23), 235314, 2007 | 48 | 2007 |
Becke-Johnson-type exchange potential for two-dimensional systems S Pittalis, E Räsänen, CR Proetto Physical Review B—Condensed Matter and Materials Physics 81 (11), 115108, 2010 | 46 | 2010 |
Gaussian approximations for the exchange-energy functional of current-carrying states: Applications to two-dimensional systems S Pittalis, E Räsänen, EKU Gross Physical Review A—Atomic, Molecular, and Optical Physics 80 (3), 032515, 2009 | 46 | 2009 |
Ensemble reduced density matrix functional theory for excited states and hierarchical generalization of Pauli’s exclusion principle C Schilling, S Pittalis Physical Review Letters 127 (2), 023001, 2021 | 43 | 2021 |
gauge invariance made simple for density functional approximations S Pittalis, G Vignale, FG Eich Physical Review B 96 (3), 035141, 2017 | 43 | 2017 |
Understanding real-time time-dependent density-functional theory simulations of ultrafast laser-induced dynamics in organic molecules J Krumland, AM Valencia, S Pittalis, CA Rozzi, C Cocchi The Journal of Chemical Physics 153 (5), 2020 | 42 | 2020 |
Phononic self-energy effects and superconductivity in CaC A Sanna, S Pittalis, JK Dewhurst, M Monni, S Sharma, G Ummarino, ... Physical Review B—Condensed Matter and Materials Physics 85 (18), 184514, 2012 | 42 | 2012 |
Comparison of exact-exchange calculations for solids in current-spin-density-and spin-density-functional theory S Sharma, S Pittalis, S Kurth, S Shallcross, JK Dewhurst, EKU Gross Physical Review B—Condensed Matter and Materials Physics 76 (10), 100401, 2007 | 42 | 2007 |
The role of Coulomb interaction in the superconducting properties of CaC6 and H under pressure S Massidda, F Bernardini, C Bersier, A Continenza, P Cudazzo, A Floris, ... Superconductor Science and Technology 22 (3), 034006, 2009 | 41 | 2009 |